MolNFT v1 · #156230 · protein
X-ray structure of human pparalpha ligand binding domain-saroglitazar co-crystals obtained by delipidation and cross-seeding
6LXC · Peroxisome proliferator-activated receptor alpha: “X-ray structure of human pparalpha ligand binding domain-saroglitazar co-crystals obtained by delipidation…”. X-ray diffraction, 1 ligand (EWR), 2 pockets (best druggability 0.82).…
- PDB
- 6LXC
- Type
- protein
- Length
- 257 residues
- Chains
- 1
- Method
- x-ray diffraction
- Collection
- MolNFT v1 / PDB
- Contract
- 0xDE3723766Bc32dcACD03C17BaA400A7B36837Eba
- Owner
- 0x3396CDB397284571d12822B4ae1189a8E22AAAAA
- Molecule
- Peroxisome proliferator-activated receptor alpha
- UniProt
- Q07869
- Ligands
- EWR
- Pockets
- 2 · best druggability 0.82
Structure
x-ray diffraction · 1 distinct chain · 67% helix, 5% strand (DSSP).
| Chain | Molecule | Type | Residues | Secondary structure | UniProt |
|---|---|---|---|---|---|
| A | Peroxisome proliferator-activated receptor alpha | protein | 257 | 67% helix, 5% strand | Q07869 |
Ligands and binding sites
- EWR · (2S)-2-ethoxy-3-[4-[2-[2-methyl-5-(4-methylsulfanylphenyl)pyrrol-1-yl]ethoxy]phenyl]propanoic acid · ligand · chains A
Binding sites are the residues within 4.5 Å of a ligand's heavy atoms.
Pockets
2 pockets found on a 1 Å grid, 1 with a druggability of 0.5 or more.
| Volume (ų) | Druggability | Buriedness | Lining residues | Inside | |
|---|---|---|---|---|---|
| 1 | 523 | 0.82 | 0.88 | 59 | EWR |
| 2 | 70 | 0.35 | 0.76 | 15 | empty |
Compared structures
- 6LXC · X-ray structure of human PPARalpha ligand binding domain-saroglitazar co-crystals… · the same entry in another collection · chain A against A, TM-score 1.00
- Q07869 · AlphaFold monomer V2.0 prediction for peroxisome proliferator- activated receptor alpha… · a predicted model of the same protein · chain A against A, TM-score 0.98
Analyse
- Open in the research workbench: secondary structure, accessibility, pockets, interfaces, conservation, variants, modifications, peptides and crosslinks on the 3D structure
- Every structure of UniProt Q07869
- Elsewhere: RCSB PDB 6LXC · PDBe 6LXC · UniProt Q07869
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